CID 9633839

2-(4-benzyl-1-piperazinyl)-n'-(4-(diethylamino)benzylidene)acetohydrazide

Structural Information

Molecular Formula
C24H33N5O
SMILES
CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)CN2CCN(CC2)CC3=CC=CC=C3
InChI
InChI=1S/C24H33N5O/c1-3-29(4-2)23-12-10-21(11-13-23)18-25-26-24(30)20-28-16-14-27(15-17-28)19-22-8-6-5-7-9-22/h5-13,18H,3-4,14-17,19-20H2,1-2H3,(H,26,30)/b25-18+
InChIKey
NHITXAYGLJKRIZ-XIEYBQDHSA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

407.26852 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 408.27580 202.1
[M+Na]+ 430.25774 202.4
[M-H]- 406.26124 209.4
[M+NH4]+ 425.30234 209.2
[M+K]+ 446.23168 197.9
[M+H-H2O]+ 390.26578 188.8
[M+HCOO]- 452.26672 221.9
[M+CH3COO]- 466.28237 237.0
[M+Na-2H]- 428.24319 203.4
[M]+ 407.26797 199.6
[M]- 407.26907 199.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.